BDBM42990 2-(benzylsulfanyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile::2-(benzylthio)-1-pyrindan-3-carbonitrile::2-(phenylmethylsulfanyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile::2-(phenylmethylthio)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile::2-benzylsulfanyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile::MLS000547061::SMR000114226::cid_681250

SMILES N#Cc1cc2CCCc2nc1SCc1ccccc1

InChI Key InChIKey=XKCTWSPTFNMSQW-UHFFFAOYSA-N

Data  1 IC50  3 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 42990   

TargetNuclear receptor coactivator 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM42990(2-(phenylmethylthio)-6,7-dihydro-5H-cyclopenta[b]p...)
Affinity DataEC50:  4.10E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/20/2011
Entry Details
PCBioAssay
TargetNuclear receptor coactivator 3(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM42990(2-(phenylmethylthio)-6,7-dihydro-5H-cyclopenta[b]p...)
Affinity DataEC50:  5.66E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center http://molscreen.florida.scripps.edu/ Center Affiliation: The ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay
TargetNuclear receptor coactivator 2(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM42990(2-(phenylmethylthio)-6,7-dihydro-5H-cyclopenta[b]p...)
Affinity DataEC50:  4.52E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay
TargetEstrogen receptor beta(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM42990(2-(phenylmethylthio)-6,7-dihydro-5H-cyclopenta[b]p...)
Affinity DataIC50: 25.4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay